SCHEMBL28637452

SCHEMBL28637452

N=C(N)NCCCC(CNC(CC1CCCC1)C(=O)NC(CCCCN)C(N)=O)NC(=O)C(N)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 7/20 0.45
▸ CPB2 Q96IY4 1/20 0.45
▸ NPY4R P50391 3/20 0.45
▸ NPY1R P25929 2/20 0.45
▸ NPY2R P49146 2/20 0.45
▸ NPY5R Q15761 2/20 0.45
▸ KISS1R Q969F8 2/20 0.44
▸ OPRL1 P41146 3/20 0.44
▸ OPRD1 P41143 1/20 0.44
▸ OPRK1 P41145 6/20 0.43
▸ IL23R Q5VWK5 1/20 0.43
▸ MMP1 P03956 1/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ MMP3 P08254 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28637450 1.00 OPRM1 (0.45) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL28645300 0.94 OPRM1 (0.43) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28645296 0.94 OPRM1 (0.43) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28652444 0.94 NPY4R (0.46) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL28652449 0.94 NPY4R (0.46) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL22117544 0.92 NPY4R (0.50) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL22117546 0.92 NPY4R (0.50) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL22117405 0.91 KISS1R (0.51) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL22117404 0.91 KISS1R (0.51) OPRM1CPB2NPY4RNPY1RNPY2R
SCHEMBL28656946 0.89 NMT1 (0.42) CPB2NPY4RNPY1RNPY2RNPY5R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113544138-A Mitochondrial targeting peptides 隐形生物治疗公司 2021-10-22 — — CN disclosed
Send feedback